MMs01061739 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7585 -1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 -1.2843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0169 -2.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2754 -3.8823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5169 -2.5686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2584 -1.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7583 -1.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5168 -2.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7753 -3.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2753 -3.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0168 -2.5392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7583 -1.2353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2582 -1.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9997 0.0784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4905 0.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7927 1.7141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4888 2.4556 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3807 1.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1591 2.3332 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.5400 3.6995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7781 0.9669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5254 2.9522 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.8293 2.2107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9374 3.2217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3184 4.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8276 4.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0353 0.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6068 1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0353 -0.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3665 -1.7119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9746 -2.4745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6516 -0.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3515 -0.2118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3821 -4.8882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6821 -4.9059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 -3.5745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0576 -2.4086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3885 -1.6286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2992 -0.6416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2053 1.6865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1303 1.2353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7263 1.4136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6491 2.2555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9727 3.8284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4572 4.9662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0612 5.7601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6334 4.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8198 5.6214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END